⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28202622 | 0.97 | PAOX (0.37) | — | |
| SCHEMBL8048914 | 0.93 | PAOX (0.48) | — | |
| SCHEMBL9061539 | 0.85 | — | — | |
| SCHEMBL4230818 | 0.84 | TSHR (0.50) | — | |
| SCHEMBL7517720 | 0.82 | LMNA (0.32) | — | |
| SCHEMBL1231151 | 0.81 | — | — | |
| SCHEMBL118049 | 0.80 | ALDH1A1 (0.59) | — | |
| SCHEMBL7702557 | 0.80 | ALDH1A1 (0.59) | — | |
| SCHEMBL745703 | 0.80 | ALDH1A1 (0.59) | — | |
| SCHEMBL15109890 | 0.80 | ALDH1A1 (0.59) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118175983-A | Hair treatment composition | 莱雅公司 | 2024-06-11 | — | — | CN | disclosed |
| CN-113271917-B | Hair care and conditioning compositions | 莱雅公司 | 2023-07-07 | — | — | CN | disclosed |
| US-7595411-B2 | Phospholipid-analogous compounds | MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E.V. (DE) | 2009-09-29 | — | — | US | disclosed |
| US-20050165245-A1 | Phospholipid-analogous compounds | MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) | 2005-07-28 | — | — | US | disclosed |
| US-6344576-B1 | CATIONIC PHOSPHATIDES AND GLYCERIDES | MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2002-02-05 | — | — | US | disclosed |
| EP-1102775-A1 | NOVEL PHOSPHOLIPIDS WITH UNSATURATED ALKYL AND ACYL CHAINS | Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2001-05-30 | — | — | EP | disclosed |
| WO-2000008031-A1 | NOVEL PHOSPHOLIPIDS WITH UNSATURATED ALKYL AND ACYL CHAINS | MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2000-02-17 | — | — | WO | disclosed |
| EP-0151678-A1 | Stable liquid detergent compositions | THE PROCTER & GAMBLE COMPANY (US) | 1985-08-21 | — | — | EP | disclosed |
| US-4245110-A | Polyalkylene oxide-containing urethane polyols with sulphonic acid groups | BAYER AKTIENGESELLSCHAFT (DE) | 1981-01-13 | — | — | US | disclosed |